# generated using pymatgen data_TaNb3Co2N _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.22822252 _cell_length_b 8.22822299 _cell_length_c 8.22822252 _cell_angle_alpha 119.99999810 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999810 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaNb3Co2N _chemical_formula_sum 'Ta4 Nb12 Co8 N4' _cell_volume 393.91555967 _cell_formula_units_Z 4 loop_ _symmetry_equiv_pos_site_id _symmetry_equiv_pos_as_xyz 1 'x, y, z' loop_ _atom_site_type_symbol _atom_site_label _atom_site_symmetry_multiplicity _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ta Ta0 1 0.00000000 0.00000000 0.00000000 1.0 Ta Ta1 1 0.50000000 0.00000000 0.00000000 1.0 Ta Ta2 1 0.50000000 0.50000000 0.00000000 1.0 Ta Ta3 1 0.50000000 0.50000000 0.50000000 1.0 Nb Nb4 1 0.31239733 0.75000100 0.18760267 1.0 Nb Nb5 1 0.93760367 0.37520634 0.18760267 1.0 Nb Nb6 1 0.93760367 0.75000100 0.18760267 1.0 Nb Nb7 1 0.68760367 0.87520634 0.43760267 1.0 Nb Nb8 1 0.68760367 0.25000100 0.43760267 1.0 Nb Nb9 1 0.06239833 0.25000100 0.43760367 1.0 Nb Nb10 1 0.31239733 0.12479366 0.56239833 1.0 Nb Nb11 1 0.31239733 0.75000100 0.56239833 1.0 Nb Nb12 1 0.93760367 0.75000100 0.56239833 1.0 Nb Nb13 1 0.68760367 0.25000100 0.81239833 1.0 Nb Nb14 1 0.06239733 0.62479366 0.81239833 1.0 Nb Nb15 1 0.06239733 0.25000100 0.81239833 1.0 Co Co16 1 0.70704855 0.91409710 0.12114765 1.0 Co Co17 1 0.29295145 0.08590190 0.20704855 1.0 Co Co18 1 0.29295145 0.41409810 0.20704855 1.0 Co Co19 1 0.62114765 0.41409810 0.20704855 1.0 Co Co20 1 0.70704855 0.58590190 0.79295145 1.0 Co Co21 1 0.70704855 0.91409710 0.79295145 1.0 Co Co22 1 0.37885235 0.58590190 0.79295145 1.0 Co Co23 1 0.29295145 0.08590190 0.87885235 1.0 N N24 1 0.00000000 0.50000000 0.00000000 1.0 N N25 1 0.00000000 0.00000000 0.50000000 1.0 N N26 1 0.50000000 0.00000000 0.50000000 1.0 N N27 1 0.00000000 0.50000000 0.50000000 1.0